N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide

C20H24N2O3S — CID 1071416

IUPACN-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide
SMILESCC1CCN(S(=O)(=O)c2ccc(NC(=O)Cc3ccccc3)cc2)CC1
InChIInChI=1S/C20H24N2O3S/c1-16-11-13-22(14-12-16)26(24,25)19-9-7-18(8-10-19)21-20(23)15-17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3,(H,21,23)
InChIKeyNYIDRMNVWWXQDA-UHFFFAOYSA-N
MW372.49 g/mol
LogP3.29
Rot. Bonds5

About N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide

N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide (PubChem CID 1071416) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide
PubChem CID1071416
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC NameN-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide
SMILESCC1CCN(S(=O)(=O)c2ccc(NC(=O)Cc3ccccc3)cc2)CC1
InChIInChI=1S/C20H24N2O3S/c1-16-11-13-22(14-12-16)26(24,25)19-9-7-18(8-10-19)21-20(23)15-17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3,(H,21,23)
InChIKeyNYIDRMNVWWXQDA-UHFFFAOYSA-N
XLogP3.29
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide?
The IUPAC name of N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide (CID 1071416) is N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide.
What is the SMILES notation for N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide?
The canonical SMILES for N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide is CC1CCN(S(=O)(=O)c2ccc(NC(=O)Cc3ccccc3)cc2)CC1.
What is the InChIKey of N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide?
The InChIKey is NYIDRMNVWWXQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-16-11-13-22(14-12-16)26(24,25)19-9-7-18(8-10-19)21-20(23)15-17-5-3-2-4-6-17/h2-10,16H,11-15H2,1H3,(H,21,23).
What are the key properties of N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide?
N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide has a molecular weight of 372.49 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-phenylacetamide is sourced from PubChem (CID 1071416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).